Geometry & MOs

Info

ID:	191095
PubChem CID:	78103142
Reduced:	ClOF3N4H10C17 (1)
Stoich.:	ABC3D4E10F17 (1)
Weight, g/mol:	392.065173
ΔH_f, kcal/mol:	-58.54
Dipole, Da:	3.18
IP(EA), eV:	-9.75(-2.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(6-chloro-5-methylpyridin-3-yl)-5-(2,2,2-trifluoroethyl)-7H-pyrazolo[4,3-c]quinolin-4-one

Drug info:

PubChemData

Smile

C1=CC2=C3C(=CN=N3)C(=O)N(C2=CC1C4=CN=C(C=C4)Cl)CC(F)(F)F

DOS

IR

Vibrations